Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AR | P10275 | 2/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL9447165 | 0.96 | GRM2 (0.33) | AR | |
| SCHEMBL9447369 | 0.93 | AR (0.33) | AR | |
| SCHEMBL9447257 | 0.80 | OPRL1 (0.35) | AR | |
| SCHEMBL9447246 | 0.80 | OPRL1 (0.35) | AR | |
| SCHEMBL9631024 | 0.78 | TP53 (0.33) | MAPT | |
| SCHEMBL9447355 | 0.77 | OPRL1 (0.39) | ARCYP1A2MAPT | |
| SCHEMBL9447161 | 0.77 | HTR2A (0.37) | ARCYP1A2 | |
| SCHEMBL9447169 | 0.77 | HTR2A (0.37) | ARCYP1A2 | |
| SCHEMBL9447349 | 0.77 | OPRL1 (0.39) | ARCYP1A2MAPT | |
| SCHEMBL9447226 | 0.77 | OPRL1 (0.34) | MAPT |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5211878-A | Difluorobenzonitrile derivatives | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1993-05-18 | — | — | US | disclosed |
| US-5178790-A | With excellent steepness of characteristics | MERCK PATENT GESELLSCHAFT MIT BESCHRAENKTER HAFTUNG (DE) | 1993-01-12 | — | — | US | disclosed |
| EP-0360851-A1 | SUPERTWIST LIQUID CRYSTAL DISPLAY | MERCK PATENT GmbH (DE) | 1990-04-04 | — | — | EP | disclosed |
| WO-1989008691-A1 | SUPERTWIST LIQUID CRYSTAL DISPLAY | MERCK Patent Gesellschaft mit beschränkter Haftung (DE) | 1989-09-21 | — | — | WO | disclosed |